%chk=000248406.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248406

0 1
S -1.775447 0.069026 0.005059
O -2.250527 1.354624 -0.507822
O -2.308577 -1.182820 -0.533839
N -2.237869 0.062876 1.654854
N 2.067016 1.189691 0.145492
N 2.011977 -1.228462 0.118265
N 0.133546 2.474160 -0.087208
N 0.021964 -2.418217 -0.140209
C -0.097841 0.031015 -0.025168
C 0.685115 1.225944 0.001662
C 0.630024 -1.198814 -0.024928
C 2.651451 -0.034225 0.220761
H -2.664060 0.898523 2.047565
H -2.701372 -0.760526 2.030944
H 3.747952 -0.060924 0.354601
H 0.737619 3.287523 -0.098523
H -0.855120 2.617300 -0.343899
H 0.588146 -3.257878 -0.169698
H -0.972297 -2.510415 -0.398909


%chk=000248406-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248406

0 1
S -1.864022 0.069741 0.030172
O -2.395002 1.516612 -0.536853
O -2.455134 -1.341568 -0.565770
N -2.298614 0.060294 1.811123
N 2.120342 1.199974 0.113484
N 2.063693 -1.240095 0.087828
N 0.187453 2.493963 -0.097524
N 0.071717 -2.437400 -0.149831
C -0.004418 0.029906 -0.029992
C 0.742946 1.251542 -0.007559
C 0.685383 -1.224814 -0.033614
C 2.679383 -0.034522 0.177833
H -2.804048 0.935479 2.029323
H -2.844816 -0.794756 2.010117
H 3.765807 -0.061112 0.310306
H 0.827609 3.286065 -0.065362
H -0.810435 2.598106 -0.322954
H 0.673555 -3.259479 -0.134867
H -0.929700 -2.489536 -0.376860


